(phenylmethyl) 2-[3-azido-2-(iodanylmethyl)-4-oxidanylidene-azetidin-1-yl]-2-oxidanyl-ethanoate

Systemtic Name: (phenylmethyl) 2-[3-azido-2-(iodanylmethyl)-4-oxidanylidene-azetidin-1-yl]-2-oxidanyl-ethanoate Openeye Name: benzyl 2-[3-azido-2-(iodomethyl)-4-oxo-azetidin-1-yl]-2-hydroxy-acetate CAS Name: 2-[3-azido-2-(iodomethyl)-4-oxo-1-azetidinyl]-2-hydroxyacetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[3-azido-2-(iodomethyl)-4-oxoazetidin-1-yl]-2-hydroxyacetate Traditional Name: 2-[3-azido-2-(iodomethyl)-4-keto-azetidin-1-yl]-2-hydroxy-acetic acid benzyl ester Formula: C13H13IN4O4 MolecularWeight: 416.17119

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(N2C(C(C2=O)N=[N+]=[N-])CI)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C(N2C(C(C2=O)N=[N+]=[N-])CI)O

InChI

InChI=1S/C13H13IN4O4/c14-6-9-10(16-17-15)11(19)18(9)12(20)13(21)22-7-8-4-2-1-3-5-8/h1-5,9-10,12,20H,6-7H2